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O-PHOSPHONATOMETHYL-2-(N-METHYL-PYRROLIDINIUM)-ETHANOL
SpectraBase Compound ID GW30rUs0qQm
InChI InChI=1S/C8H18NO4P/c1-9(4-2-3-5-9)6-7-13-8-14(10,11)12/h2-8H2,1H3,(H-,10,11,12)
InChIKey UVKBECHWBZIGKD-UHFFFAOYSA-N
Mol Weight 223.21 g/mol
Molecular Formula C8H18NO4P
Exact Mass 223.097345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7RVXfreGO
Name O-PHOSPHONATOMETHYL-2-(N-METHYL-PYRROLIDINIUM)-ETHANOL
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H17NO4P
InChI InChI=1S/C8H18NO4P/c1-9(4-2-3-5-9)6-7-13-8-14(10,11)12/h2-8H2,1H3,(H-,10,11,12)
InChIKey UVKBECHWBZIGKD-UHFFFAOYSA-N
Literature Reference Author A.HOLY,B.OTOVA,M.BUDESINSKY,D.EMERSON,M.E.WILES
Literature Reference Citation J.MED.CHEM.,44,4462(2001)
Literature Reference DOI 10.1021/jm010974h
Molecular Weight 222.201 g/mol
Sample ID 45223
Solvent D2O